N-[[[4-[(4-ethoxyphenyl)amino]-4-oxidanylidene-butanoyl]amino]carbamothioyl]-2-pentoxy-benzamide

Systemtic Name: N-[[[4-[(4-ethoxyphenyl)amino]-4-oxidanylidene-butanoyl]amino]carbamothioyl]-2-pentoxy-benzamide Openeye Name: N-[[[4-(4-ethoxyanilino)-4-oxo-butanoyl]amino]carbamothioyl]-2-pentoxy-benzamide CAS Name: N-[[[4-(4-ethoxyanilino)-1,4-dioxobutyl]hydrazo]-sulfanylidenemethyl]-2-pentoxybenzamide IUPAC Name: N-[[[4-(4-ethoxyanilino)-4-oxobutanoyl]amino]carbamothioyl]-2-pentoxybenzamide Traditional Name: 2-amoxy-N-[[[4-keto-4-(p-phenetidino)butanoyl]amino]thiocarbamoyl]benzamide Formula: C25H32N4O5S MolecularWeight: 500.61038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)CCC(=O)NC2=CC=C(C=C2)OCC

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)CCC(=O)NC2=CC=C(C=C2)OCC

InChI

InChI=1S/C25H32N4O5S/c1-3-5-8-17-34-21-10-7-6-9-20(21)24(32)27-25(35)29-28-23(31)16-15-22(30)26-18-11-13-19(14-12-18)33-4-2/h6-7,9-14H,3-5,8,15-17H2,1-2H3,(H,26,30)(H,28,31)(H2,27,29,32,35)